ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010735
RECORD_TITLE: PROPYZAMIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

CH$NAME: PROPYZAMIDE
CH$NAME: 3,5-DICHLORO-N-(1,1-DIMETHYL-2-PROPYNYL)BENZAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₁Cl₂NO
CH$EXACT_MASS: 255.02177
CH$SMILES: C#CC(C)(C)NC(=O)c(c1)cc(Cl)cc(Cl)1
CH$IUPAC: InChI=1S/C12H11Cl2NO/c1-4-12(2,3)15-11(16)8-5-9(13)7-10(14)6-8/h1,5-7H,2-3H3,(H,15,16)
CH$LINK: INCHIKEY PHNUZKMIPFFYSO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2020420

AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-05i0-2940000000-1b332b7936e90b0f48c4
PK$NUM_PEAK: 40
PK$PEAK: m/z int. rel.int.
  41 4.73 47
  42 2.29 23
  55 1.67 17
  56 2.26 23
  57 2.57 26
  65 2 20
  66 8.18 82
  67 5.35 54
  68 1.31 13
  69 2.22 22
  82 5.41 54
  83 3.04 30
  84 13.42 134
  110 2.58 26
  138 1.44 14
  145 11.95 120
  146 1.15 12
  147 7.37 74
  149 1.47 15
  172 2.14 21
  173 99.99 999
  174 8.83 88
  175 63.83 638
  176 5.47 55
  177 10.9 109
  179 1.98 20
  190 1.31 13
  191 1.11 11
  192 1.55 16
  202 1.14 11
  240 11.11 111
  241 1.47 15
  242 7.2 72
  244 1.22 12
  254 20.09 201
  255 32.25 323
  256 17.58 176
  257 20.59 206
  258 4.73 47
  259 3.45 35
//